Glycoside
GD085215
Name:
NoneFormula:
C15H17O7NCl2SSmiles:
Cc1c(Cl)ccc(S(=O)(=O)N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)c1ClAglycone:
Cc1c(Cl)ccc(S(N)(=O)=O)c1ClSugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 8 |
| MolWt: | 402.25 | Num_heavy_atoms: | 24 |
| TPSA: | 144.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD37763
Formula: C9H7O2NCl2S
Smiles:
Cc1c(Cl)ccc(S(N)(=O)=O)c1Cl| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.95 | Num_rotatable_bonds: | 1 |
| MolWt: | 240.11 | Num_heavy_atoms: | 13 |
| TPSA: | 60.16 | NumAromaticRings: | 1 |
